diphenylmethanone;propan-1-amine

C16H19NO — CID 174497329

IUPACdiphenylmethanone;propan-1-amine
SMILESCCCN.O=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H10O.C3H9N/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2-3-4/h1-10H;2-4H2,1H3
InChIKeyWJKPXGCDUSEQHK-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.27
Rot. Bonds3

About diphenylmethanone;propan-1-amine

diphenylmethanone;propan-1-amine (PubChem CID 174497329) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is diphenylmethanone;propan-1-amine.

Molecular Properties

Compound Namediphenylmethanone;propan-1-amine
PubChem CID174497329
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Namediphenylmethanone;propan-1-amine
SMILESCCCN.O=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C13H10O.C3H9N/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2-3-4/h1-10H;2-4H2,1H3
InChIKeyWJKPXGCDUSEQHK-UHFFFAOYSA-N
XLogP3.27
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze diphenylmethanone;propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

diphenylmethanone;ethane
CID 158014879
diphenylmethanone
CID 3102
butane;(4-hydroxyphenyl)-phenylmethanone
CID 70634619
diphenylmethanone;ethyl 3-amino-2-hydroxypropanoate
CID 174970352
diphenylmethanone;propanal
CID 159329764
diphenylmethanone;gold
CID 174931146
disodium;diphenylmethanone
CID 19380838
cobalt(2+);diphenylmethanone
CID 19033779
bis(diphenylmethanone);dihydrochloride
CID 69107757
(2-nitrophenyl)-phenylmethanone;propan-1-amine
CID 20502317
[4-(2-aminoethyl)phenyl]-phenylmethanone
CID 14368635
acetic acid;diphenylmethanone;hydrate
CID 161284686

Frequently Asked Questions

What is the IUPAC name of diphenylmethanone;propan-1-amine?
The IUPAC name of diphenylmethanone;propan-1-amine (CID 174497329) is diphenylmethanone;propan-1-amine.
What is the SMILES notation for diphenylmethanone;propan-1-amine?
The canonical SMILES for diphenylmethanone;propan-1-amine is CCCN.O=C(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenylmethanone;propan-1-amine?
The InChIKey is WJKPXGCDUSEQHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10O.C3H9N/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;1-2-3-4/h1-10H;2-4H2,1H3.
What are the key properties of diphenylmethanone;propan-1-amine?
diphenylmethanone;propan-1-amine has a molecular weight of 241.33 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diphenylmethanone;propan-1-amine is sourced from PubChem (CID 174497329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).